EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C12H7N5O9 |
| Net Charge | 0 |
| Average Mass | 365.214 |
| Monoisotopic Mass | 365.02438 |
| SMILES | O=C(N/N=C\c1ccc([N+](=O)[O-])o1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O |
| InChI | InChI=1S/C12H7N5O9/c18-11-8(3-6(15(20)21)4-9(11)16(22)23)12(19)14-13-5-7-1-2-10(26-7)17(24)25/h1-5,18H,(H,14,19)/b13-5- |
| InChIKey | XXUXXCZCUGIGPP-ACAGNQJTSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Bos taurus (ncbitaxon:9913) | spermatozoon (BTO:0001277) | MetaboLights (MTBLS1071) | Strain: Holstein [LBO:0000132] |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-Hydroxy-3,5-dinitro-N-[(1Z)-(5-nitrofuran-2-yl)methylidene]benzene-1-carbohydrazonic acid (CHEBI:184414) is a dinitrophenol (CHEBI:39352) |
| IUPAC Name |
|---|
| 2-hydroxy-3,5-dinitro-N-[(Z)-(5-nitrouran-2-yl)methylideneamino]benzamide |
| Manual Xrefs | Databases |
|---|---|
| HMDB0031764 | HMDB |
| 16741381 | ChemSpider |